0 B19R2.18045 C[C@@H](c1nc(no1)CCc2ccccc2)N(C)C 270196a_100000212256_100009822176 [0,0,0,0,0,0|3,0,1]=4 1 B18R2.9358 CNC(=O)c1cn(nn1)CCc2ccccc2 274090a_100011218657_100000703847 [1,0,0,0,0,0|3,0,0]=4 2 B18R2.9880 CC(C)Cn1cc(nn1)CCc2ccccc2 274090a_100000210760_100000035266 [1,0,0,0,0,0|2,0,1]=4 3 B18R2.9880 CN(C)Cc1nc(no1)CCc2ccccc2 270196a_100000212256_100000750896 [1,0,0,0,0,0|2,0,1]=4 4 B20R2.171534 CN(C)C(C)(C)n1cc(nn1)CCc2ccccc2 274090a_217856628674_100000035266 [0,1,0,0,0,0|2,0,1]=4 5 B18R1.93129 CCC(=NNC(=O)C(C)C)CCc1ccccc1 4a_100000184118_100011279265 [0,0,1,0,0,0|3,0,0]=4 6 B20R2.24565 CC(C)C(=O)Cc1noc(n1)CCc2ccccc2 270196a_100000737028_100000185753 [0,0,0,0,0,1|3,0,0]=4 7 B20R2.24565 CC(C)C(=O)Cn1cc(nn1)CCc2ccccc2 274090a_100000753385_100000035266 [0,0,0,0,0,1|2,0,0]=3 8 B20R2.24565 CC(C)C(=O)Cn1cc(nn1)COc2ccccc2 274090a_100000753385_100000172638 [0,0,0,0,0,1|3,0,0]=4 9 B20R2.24565 CC(C)C(=O)Cn1cc(nn1)CSc2ccccc2 274090a_100000753385_200000172648 [0,0,0,0,0,1|3,0,0]=4 10 B20R2.24565 CC(C)C(=O)Cn1nnc(n1)COc2ccccc2 1458a_100000706184_100000210206 [0,0,0,0,0,1|2,0,0]=3 11 B20R2.24565 CN(C)C(=O)Cc1noc(n1)CCc2ccccc2 270196a_100000185882_100000185753 [0,0,0,0,0,1|2,0,0]=3 12 B20R2.24565 CN(C)C(=O)Cc1noc(n1)CCc2cccnc2 270196a_100000185882_100000198484 [0,0,0,0,0,1|3,0,0]=4 13 B20R2.24565 CN(C)C(=O)Cc1noc(n1)CCc2ccncc2 270196a_100000185882_100011225043 [0,0,0,0,0,1|3,0,0]=4 14 B20R2.24565 CN(C)C(=O)Cc1noc(n1)COc2ccccc2 270196a_100000185882_100000186222 [0,0,0,0,0,1|3,0,0]=4 15 B20R2.24565 CN(C)C(=O)Cc1noc(n1)CSc2ccccc2 270196a_100000185882_100000211596 [0,0,0,0,0,1|3,0,0]=4 16 B20R2.24565 CN(C)C(=O)Cn1cc(nn1)CCc2ccccc2 274090a_100000185267_100000035266 [0,0,0,0,0,1|1,0,0]=2 17 B20R2.24565 CN(C)C(=O)Cn1cc(nn1)COc2ccccc2 274090a_100000185267_100000172638 [0,0,0,0,0,1|2,0,0]=3 18 B20R2.24565 CN(C)C(=O)Cn1cc(nn1)COc2cccnc2 274090a_100000185267_200012001738 [0,0,0,0,0,1|3,0,0]=4 19 B20R2.24565 CN(C)C(=O)Cn1cc(nn1)CSc2ccccc2 274090a_100000185267_200000172648 [0,0,0,0,0,1|2,0,0]=3 20 B20R2.24565 CN(C)C(=O)Cn1nnc(n1)COc2ccccc2 11a_100102631434_100000706184 [0,0,0,0,0,1|1,0,0]=2 21 B20R2.24565 CN(C)C(=O)Cn1nnc(n1)COc2ccccc2 1626a_100102631434_100000706184 [0,0,0,0,0,1|1,0,0]=2 22 B20R2.24565 CN(C)C(=O)Cn1nnc(n1)COc2ccccc2 240690a_100102631434_100000706184 [0,0,0,0,0,1|1,0,0]=2 23 B20R2.68306 CC(CN(C)C)n1cc(nn1)CCc2ccccc2 274090a_100020606517_100000035266 [0,0,0,0,0,1|2,0,1]=4 24 B17R1.16633 CC(=NNC(=O)C(C)C)CCc1ccccc1 4a_100000184118_100000210092 [1,0,1,0,0,0|2,0,0]=4 25 B17R2.5637 NC(=O)c1nc(no1)CCc2ccccc2 270196a_100000212256_100011215815 [2,0,0,0,0,0|2,0,0]=4 26 B21R2.20106 CN(C)C(=O)Cc1noc(n1)CCc2ccc(cc2)Cl 270196a_100000185882_100000235379 [0,1,0,0,0,1|2,0,0]=4 27 B21R2.20106 CN(C)C(=O)Cc1noc(n1)CCc2ccc(cc2)F 270196a_100000185882_100000198493 [0,1,0,0,0,1|2,0,0]=4 28 B21R2.20106 CN(C)C(=O)Cc1noc(n1)CCc2ccc(cc2)I 270196a_100000185882_100011217499 [0,1,0,0,0,1|2,0,0]=4 29 B21R2.20106 CN(C)C(=O)Cc1noc(n1)CCc2ccc(cc2)O 270196a_100000185882_100000742835 [0,1,0,0,0,1|2,0,0]=4 30 B21R2.20106 CN(C)C(=O)Cn1cc(nn1)COc2ccc(cc2)Br 274090a_100000185267_100000172629 [0,1,0,0,0,1|2,0,0]=4 31 B21R2.20106 CN(C)C(=O)Cn1cc(nn1)COc2ccc(cc2)Cl 274090a_100000185267_100000172631 [0,1,0,0,0,1|2,0,0]=4 32 B21R2.20106 CN(C)C(=O)Cn1cc(nn1)COc2ccc(cc2)F 274090a_100000185267_100000172637 [0,1,0,0,0,1|2,0,0]=4 33 B21R2.20106 CN(C)C(=O)Cn1cc(nn1)COc2ccc(cc2)I 274090a_100000185267_100000172739 [0,1,0,0,0,1|2,0,0]=4 34 B21R2.20106 CN(C)C(=O)Cn1cc(nn1)COc2ccc(cc2)N 274090a_100000185267_100000753246 [0,1,0,0,0,1|2,0,0]=4 35 B21R2.20106 Cc1ccc(cc1)CCc2nc(no2)CC(=O)N(C)C 270196a_100000185882_100000234883 [0,1,0,0,0,1|2,0,0]=4 36 B21R2.32663 CC(Cc1nc(no1)CC(=O)N(C)C)c2ccccc2 270196a_100000185882_100000183687 [0,1,0,0,0,1|2,0,0]=4 37 B21R2.32663 CN(C)C(=O)Cc1noc(n1)CC(O)c2ccccc2 270196a_100000185882_100000690199 [0,1,0,0,0,1|2,0,0]=4 38 B21R2.32663 CN(C)C(=O)Cn1cc(nn1)CN(C)c2ccccc2 274090a_100000185267_100000209185 [0,1,0,0,0,1|2,0,0]=4 39 B21R2.32670 CC(C)C(=O)Cn1cc(nn1)C(O)Cc2ccccc2 274090a_100000753385_100000685211 [0,1,0,0,0,1|2,0,0]=4 40 B21R2.32670 CC(Cc1ccccc1)c2nc(no2)CC(=O)N(C)C 270196a_100000185882_100000754839 [0,1,0,0,0,1|2,0,0]=4 41 B21R2.32670 CN(C)C(=O)Cc1noc(n1)[C@H](O)Cc2ccccc2 270196a_100000185882_100009816399 [0,1,0,0,0,1|2,0,0]=4 42 B21R2.32670 CN(C)C(=O)Cn1cc(nn1)C(O)Cc2ccccc2 274090a_100000185267_100000685211 [0,1,0,0,0,1|1,0,0]=3 43 B21R2.104948 CC(C(=O)N(C)C)n1cc(nn1)CCc2ccccc2 274090a_100000209910_100000035266 [0,1,0,0,0,1|1,0,0]=3 44 B21R2.104948 CC(C(=O)N(C)C)n1cc(nn1)COc2ccccc2 274090a_100000209910_100000172638 [0,1,0,0,0,1|2,0,0]=4 45 B21R2.104948 CC(C(=O)N(C)C)n1cc(nn1)CSc2ccccc2 274090a_100000209910_200000172648 [0,1,0,0,0,1|2,0,0]=4 46 B21R2.104948 CC(C)C(=O)C(C)n1cc(nn1)CCc2ccccc2 274090a_100009893295_100000035266 [0,1,0,0,0,1|2,0,0]=4 47 B21R2.143111 CN(C)C(=O)Cc1noc(n1)CCc2ccccc2Br 270196a_100000185882_100000740810 [0,1,0,0,0,1|2,0,0]=4 48 B21R2.143111 CN(C)C(=O)Cc1noc(n1)CCc2ccccc2Cl 270196a_100000185882_100000184300 [0,1,0,0,0,1|2,0,0]=4 49 B21R2.143111 CN(C)C(=O)Cc1noc(n1)CCc2ccccc2F 270196a_100000185882_100000189703 [0,1,0,0,0,1|2,0,0]=4 50 B21R2.143111 CN(C)C(=O)Cc1noc(n1)CCc2ccccc2I 270196a_100000185882_100000037306 [0,1,0,0,0,1|2,0,0]=4 51 B21R2.143111 CN(C)C(=O)Cc1noc(n1)CCc2ccccc2O 270196a_100000185882_100000181328 [0,1,0,0,0,1|2,0,0]=4 52 B21R2.143111 CN(C)C(=O)Cn1cc(nn1)COc2ccccc2Br 274090a_100000185267_100000173974 [0,1,0,0,0,1|2,0,0]=4 53 B21R2.143111 CN(C)C(=O)Cn1cc(nn1)COc2ccccc2Cl 274090a_100000185267_100000172630 [0,1,0,0,0,1|2,0,0]=4 54 B21R2.143111 CN(C)C(=O)Cn1cc(nn1)COc2ccccc2F 274090a_100000185267_100000173115 [0,1,0,0,0,1|2,0,0]=4 55 B21R2.143111 CN(C)C(=O)Cn1cc(nn1)COc2ccccc2N 274090a_100000185267_100000707309 [0,1,0,0,0,1|2,0,0]=4 56 B21R2.143111 Cc1ccccc1CCc2nc(no2)CC(=O)N(C)C 270196a_100000185882_100000748742 [0,1,0,0,0,1|2,0,0]=4 57 B21R2.143111 Cc1ccccc1OCc2cn(nn2)CC(=O)N(C)C 274090a_100000185267_100000172636 [0,1,0,0,0,1|2,0,0]=4 58 B21R2.223279 CN(C)C(=O)Cc1noc(n1)CCc2cccc(c2)Br 270196a_100000185882_100000184314 [0,1,0,0,0,1|2,0,0]=4 59 B21R2.223279 CN(C)C(=O)Cc1noc(n1)CCc2cccc(c2)Cl 270196a_100000185882_100000235675 [0,1,0,0,0,1|2,0,0]=4 60 B21R2.223279 CN(C)C(=O)Cc1noc(n1)CCc2cccc(c2)F 270196a_100000185882_100000235673 [0,1,0,0,0,1|2,0,0]=4 61 B21R2.223279 CN(C)C(=O)Cc1noc(n1)CCc2cccc(c2)I 270196a_100000185882_100010007846 [0,1,0,0,0,1|2,0,0]=4 62 B21R2.223279 CN(C)C(=O)Cc1noc(n1)CCc2cccc(c2)O 270196a_100000185882_100011216126 [0,1,0,0,0,1|2,0,0]=4 63 B21R2.223279 CN(C)C(=O)Cn1cc(nn1)COc2cccc(c2)Br 274090a_100000185267_100000172639 [0,1,0,0,0,1|2,0,0]=4 64 B21R2.223279 CN(C)C(=O)Cn1cc(nn1)COc2cccc(c2)F 274090a_100000185267_100000172650 [0,1,0,0,0,1|2,0,0]=4 65 B21R2.223279 CN(C)C(=O)Cn1cc(nn1)COc2cccc(c2)I 274090a_100000185267_100000172736 [0,1,0,0,0,1|2,0,0]=4 66 B21R2.223279 Cc1cccc(c1)CCc2nc(no2)CC(=O)N(C)C 270196a_100000185882_100000234952 [0,1,0,0,0,1|2,0,0]=4 67 B21R2.223279 Cc1cccc(c1)OCc2cn(nn2)CC(=O)N(C)C 274090a_100000185267_100000172635 [0,1,0,0,0,1|2,0,0]=4 68 B21R2.257891 CC(C)(C)C(=O)Cn1cc(nn1)CCc2ccccc2 274090a_100000210923_100000035266 [0,1,0,0,0,1|2,0,0]=4 69 B21R2.501037 CCC(C)C(=O)Cn1nnc(n1)COc2ccccc2 1458a_100000706184_100000758301 [0,1,0,0,0,1|2,0,0]=4 70 B21R2.501037 CCN(C)C(=O)Cn1cc(nn1)CCc2ccccc2 274090a_100000738999_100000035266 [0,1,0,0,0,1|1,0,0]=3 71 B21R2.501037 CCN(C)C(=O)Cn1cc(nn1)COc2ccccc2 274090a_100000738999_100000172638 [0,1,0,0,0,1|2,0,0]=4 72 B21R2.501037 CCN(C)C(=O)Cn1cc(nn1)CSc2ccccc2 274090a_100000738999_200000172648 [0,1,0,0,0,1|2,0,0]=4 73 B21R2.501037 CCN(C)C(=O)Cn1nnc(n1)COc2ccccc2 11a_100000225621_100000706184 [0,1,0,0,0,1|1,0,0]=3 74 B21R2.501037 CCN(C)C(=O)Cn1nnc(n1)COc2ccccc2 1626a_100000225621_100000706184 [0,1,0,0,0,1|1,0,0]=3 75 B21R2.501037 CCN(C)C(=O)Cn1nnc(n1)COc2ccccc2 240690a_100000225621_100000706184 [0,1,0,0,0,1|1,0,0]=3 76 B21R2.501037 CON(C)C(=O)Cn1cc(nn1)CCc2ccccc2 274090a_100000764215_100000035266 [0,1,0,0,0,1|1,0,0]=3 77 B21R2.501037 CON(C)C(=O)Cn1cc(nn1)COc2ccccc2 274090a_100000764215_100000172638 [0,1,0,0,0,1|2,0,0]=4 78 B21R2.501037 CON(C)C(=O)Cn1cc(nn1)CSc2ccccc2 274090a_100000764215_200000172648 [0,1,0,0,0,1|2,0,0]=4 79 B21R3.47917 CN(C)C(=O)Cc1noc(n1)C2Cc3c2cccc3 270196a_100000185882_200000238571 [0,0,0,1,0,1|2,0,0]=4 80 B21R3.520814 O=C(Cn1cc(nn1)CCc2ccccc2)C3CC3 274090a_100000746382_100000035266 [0,0,0,1,0,1|2,0,0]=4 81 B19R1.139899 CCC(=NNC(=O)CN(C)C)CCc1ccccc1 4a_100000750941_100011279265 [0,0,1,0,0,1|2,0,0]=4 82 B19R2.163810 CC(=CCn1cc(nn1)CCc2ccccc2)C 274090a_100000761012_100000035266 [1,0,0,0,0,1|2,0,0]=4 83 B19R2.163810 CN(C)CCn1cc(nn1)CCc2ccccc2 274090a_100000755713_100000035266 [1,0,0,0,0,1|1,0,1]=4 84 B19R2.2630 CC(C)C(=O)Cn1cc(nn1)Cc2ccccc2 274090a_100000753385_100000039852 [0,0,0,0,1,1|2,0,0]=4 85 B19R2.2630 CN(C)C(=O)Cn1cc(nn1)Cc2ccccc2 274090a_100000185267_100000039852 [0,0,0,0,1,1|1,0,0]=3 86 B21R2.32664 CC(C)C(=O)Cn1cc(nn1)CCCc2ccccc2 274090a_100000753385_100000034183 [0,0,0,0,0,2|2,0,0]=4 87 B21R2.32664 CC(C)C(=O)Cn1cc(nn1)CNCc2ccccc2 274090a_100000753385_100000730907 [0,0,0,0,0,2|2,0,0]=4 88 B21R2.32664 CC(C)C(=O)Cn1cc(nn1)COCc2ccccc2 274090a_100000753385_100000054601 [0,0,0,0,0,2|2,0,0]=4 89 B21R2.32664 CN(C)C(=O)Cc1noc(n1)CCCc2ccccc2 270196a_100000185882_100011207963 [0,0,0,0,0,2|2,0,0]=4 90 B21R2.32664 CN(C)C(=O)Cc1noc(n1)CCSc2ccccc2 270196a_100000185882_100000182436 [0,0,0,0,0,2|2,0,0]=4 91 B21R2.32664 CN(C)C(=O)Cc1noc(n1)COCc2ccccc2 270196a_100000185882_100000230186 [0,0,0,0,0,2|2,0,0]=4 92 B21R2.32664 CN(C)C(=O)Cc1noc(n1)CSCc2ccccc2 270196a_100000185882_100000150264 [0,0,0,0,0,2|2,0,0]=4 93 B21R2.32664 CN(C)C(=O)Cn1cc(nn1)CCCc2ccccc2 274090a_100000185267_100000034183 [0,0,0,0,0,2|1,0,0]=3 94 B21R2.32664 CN(C)C(=O)Cn1cc(nn1)CNCc2ccccc2 274090a_100000185267_100000730907 [0,0,0,0,0,2|1,0,0]=3 95 B21R2.32664 CN(C)C(=O)Cn1cc(nn1)COCc2ccccc2 274090a_100000185267_100000054601 [0,0,0,0,0,2|1,0,0]=3 96 B21R2.255887 CC(C)CC(=O)Cn1nnc(n1)COc2ccccc2 1458a_100000706184_100000210624 [0,0,0,0,0,2|2,0,0]=4 97 B21R2.255887 CC(C)NC(=O)Cn1cc(nn1)CCc2ccccc2 274090a_100000183996_100000035266 [0,0,0,0,0,2|2,0,0]=4 98 B21R2.255887 CC(C)NC(=O)Cn1nnc(n1)COc2ccccc2 11a_100138425928_100000706184 [0,0,0,0,0,2|2,0,0]=4 99 B21R2.255887 CC(C)NC(=O)Cn1nnc(n1)COc2ccccc2 1626a_100138425928_100000706184 [0,0,0,0,0,2|2,0,0]=4 100 B21R2.255887 CC(C)NC(=O)Cn1nnc(n1)COc2ccccc2 240690a_100138425928_100000706184 [0,0,0,0,0,2|2,0,0]=4 101 B21R2.255887 CC(C)OC(=O)Cn1cc(nn1)CCc2ccccc2 274090a_100011215430_100000035266 [0,0,0,0,0,2|2,0,0]=4 102 B21R2.257544 CC(C)C(=O)OCn1cc(nn1)CCc2ccccc2 274090a_100000139345_100000035266 [0,0,0,0,0,2|2,0,0]=4 103 B21R2.257544 CN(C)C(=O)CCc1nc(no1)CCc2ccccc2 270196a_100000212256_100011200748 [0,0,0,0,0,2|2,0,0]=4 104 B21R2.257544 CN(C)C(=O)CCn1cc(nn1)CCc2ccccc2 274090a_100000737620_100000035266 [0,0,0,0,0,2|1,0,0]=3 105 B21R2.257544 CN(C)C(=O)CCn1cc(nn1)COc2ccccc2 274090a_100000737620_100000172638 [0,0,0,0,0,2|2,0,0]=4 106 B21R2.257544 CN(C)C(=O)CCn1cc(nn1)CSc2ccccc2 274090a_100000737620_200000172648 [0,0,0,0,0,2|2,0,0]=4